Use with HelixToolkit (WPF)

Install ChemSharp.Molecules.HelixToolkit and add the following to your .xaml-Page:

<...>
<ROOTELEMENT
xmlns:h="http://helix-toolkit.org/wpf" 
xmlns:controls="clr-namespace:ChemSharp.Molecules.HelixToolkit.Controls;assembly=ChemSharp.Molecules.HelixToolkit"
>
<...>
<h:HelixViewport3D x:Name="Viewport3D"  
                   ShowViewCube="False" ShowCoordinateSystem="True" 
                   ZoomExtentsWhenLoaded="True" IsHeadLightEnabled="True">
    <h:DefaultLights/>
    <h:DirectionalHeadLight/>
    <controls:ItemsVisual3D ItemsSource="{Binding Atoms3D}"/>
    <controls:ItemsVisual3D ItemsSource="{Binding Bonds3D}"/>
</h:HelixViewport3D>

An Example MainWindow.cs could look like this:

public partial class MainWindow : Window
    {
        public MainWindow()
        {
            InitializeComponent();
            DataContext = this;
            var filename = @"F:\Repositories\ChemSharp\ChemSharp.Tests\files\ptcor.mol2";
            Molecule = Molecule.FromFile(filename);
            Atoms3D = new ObservableCollection<Atom3D>(Molecule.Atoms.Select(s => new Atom3D(s)));
            Bonds3D = new ObservableCollection<Bond3D>(Molecule.Bonds.Select(s => new Bond3D(s)));
        }

        public Molecule Molecule { get; }

        /// <summary>
        /// 3D Representation of Atoms
        /// </summary>
        public ObservableCollection<Atom3D> Atoms3D { get; }
        /// <summary>
        /// 3D Representation of Bonds
        /// </summary>
        public ObservableCollection<Bond3D> Bonds3D { get; }
    }